⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL31490930 | 0.72 | — | — | |
| SCHEMBL15627015 | 0.67 | — | — | |
| SCHEMBL5711909 | 0.67 | — | — | |
| SCHEMBL5701564 | 0.67 | — | — | |
| SCHEMBL5711905 | 0.67 | — | — | |
| SCHEMBL1347280 | 0.65 | — | — | |
| SCHEMBL346084 | 0.65 | — | — | |
| SCHEMBL521836 | 0.65 | — | — | |
| SCHEMBL4386991 | 0.62 | — | — | |
| SCHEMBL17814 | 0.62 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2002114663-A | WATER-REPELLENT COSMETIC, AGENT FOR IMPARTING WATER- REPELLENCY TO COSMETIC, METHOD FOR IMPARTING WATER- REPELLENCY TO COSMETIC, AND METHOD FOR EVALUATING WATER-REPELLENCY AND WATER-RESISTANCE OF COSMETIC | KANEBO LTD | 2002-04-16 | — | — | JP | disclosed |